SCHEMBL5585670

SCHEMBL5585670

FC(F)(F)c1ccc(N2CCNCC2)nc1OCc1ccc2c(c1)OCCO2

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.46
PRMT5 O14744 4/20 0.41
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP1A2 P05177 2/20 0.39
CYP2C19 P33261 1/20 0.39
CYP2C9 P11712 1/20 0.39
HTR2C P28335 2/20 0.39
MTOR P42345 1/20 0.39
ITGB2 P05107 4/20 0.39
ICAM1 P05362 4/20 0.39
ITGAL P20701 4/20 0.39
EPHX2 P34913 1/20 0.37
ADRB1 P08588 1/20 0.37
AR P10275 1/20 0.37
PKM P14618 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2B P41595 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5585610 0.81 ADRB2 (0.53) ADRB2PRMT5CYP1A2CYP2C19CYP2C9
SCHEMBL5585742 0.78 HTR6 (0.52) ADRB2PRMT5CYP1A2CYP2C19CYP2C9
SCHEMBL5585826 0.77 ADRB2 (0.49) ADRB2PRMT5CYP1A2CYP2C19CYP2C9
SCHEMBL3266751 0.75 HTR2C (0.64) CYP1A2CYP2C19CYP2C9HTR2CADRB1
SCHEMBL5585242 0.75 ADRB2 (0.49) ADRB2PRMT5CYP1A2CYP2C19CYP2C9
SCHEMBL5585730 0.75 ADRB2 (0.51) ADRB2PRMT5CYP1A2CYP2C19CYP2C9
SCHEMBL5585313 0.74 ADRB2 (0.55) ADRB2PRMT5CYP1A2CYP2C19CYP2C9
SCHEMBL5585592 0.73 PRMT5 (0.58) ADRB2PRMT5CYP1A2CYP2C19CYP2C9
SCHEMBL5585578 0.73 ADRB2 (0.46) ADRB2PRMT5CYP1A2CYP2C9HTR2C
SCHEMBL6185077 0.72 ADRB2 (0.51) ADRB2PRMT5CYP1A2CYP2C19CYP2C9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7229997-B2 Compounds and their use BIOVITRUM AB (SE) 2007-06-12 US claimed
EP-1506185-B1 COMPOUNDS AND THEIR USE AS INHIBITORS OF 5-HT BIOVITRUM AB (SE) 2006-05-24 EP claimed
CN-1701068-A Novel compounds and their use BIOVITRUM AB (SE) 2005-11-23 CN claimed
JP-2005529926-A 2005-10-06 JP claimed
EP-1506185-A1 NOVEL COMPOUNDS AND THEIR USE Biovitrum AB (SE) 2005-02-16 EP claimed
US-20030232814-A1 Novel compounds and their use BIOVITRUM AB (PUBL) (SE) 2003-12-18 US claimed
WO-2003097636-A1 NOVEL COMPOUNDS AND THEIR USE BIOVITRUM AB (SE) 2003-11-27 WO claimed
US-7229997-B2 Compounds and their use BIOVITRUM AB (SE) 2007-06-12 US disclosed
EP-1506185-B1 COMPOUNDS AND THEIR USE AS INHIBITORS OF 5-HT BIOVITRUM AB (SE) 2006-05-24 EP disclosed
CN-1701068-A Novel compounds and their use BIOVITRUM AB (SE) 2005-11-23 CN disclosed
EP-1506185-A1 NOVEL COMPOUNDS AND THEIR USE Biovitrum AB (SE) 2005-02-16 EP disclosed
US-20030232814-A1 Novel compounds and their use BIOVITRUM AB (PUBL) (SE) 2003-12-18 US disclosed
WO-2003097636-A1 NOVEL COMPOUNDS AND THEIR USE BIOVITRUM AB (SE) 2003-11-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030232814-A1 Novel compounds and their use GPR119, FABP4, MC4R ADRB2 63/4885PRMT5 974/4885LMNA 2979/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.